Tsuneyuki Research Group

Current Research Areas

In our laboratory, material properties under extreme conditions are studied by utilizing computer simulation methods based on
the theory of electronic state, the molecular dynamics, and the first-principle electronic state calculations.
The word "first-principle" means solving fundamental equations which rule electrons with basic physical constants such as Planck constants and eliminating empirical parameters.
The importance of the first-principle calculation is that it can be applied to the system such as extremely high-pressure condition, complicated bulk surface/interface state, and nanostructures where experimental observations are difficult or sufficient information cannot be obtained by experiments.